Duloxetine impurity 11

Name: Duloxetine impurity 11
Brand: ChemScene
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CAS No. 116539-55-0
Cat. No. CS-M3028
Purity≥97%
MDL No.MFCD07357308

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Structure of 116539-55-0

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General Information

CAS No. 116539-55-0
Cat. No. CS-M3028
Purity ≥97%
MDL No. MFCD07357308
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₁₃NOS
Molecular Weight 171.26
Synonym(s) None
SMILES CNCC[C@@H](C1=CC=CS1)O

Application

(S)-(-)-3-(N-Methylamino)-1-(2-thienyl)-1-propanol serves as a chiral building block for synthesizing bioactive heterocycles and pharmaceutical intermediates. Its thienyl moiety imparts favorable electronic properties, while the stereogenic center enables enantioselective transformations. The molecule exhibits good bench stability and compatibility with standard functional group manipulations, facilitating efficient synthesis of target scaffolds in medicinal chemistry workflows.

Synthesis

Route1
- 39145-15-8
- ~80%
- In-stock
  
  116539-55-0
References
- EP1411045 A1, ; Page 19 ;
Route2
- 1337865-86-7
- ~80%
- In-stock
  
  116539-55-0
References
- US2013/5992 A1, ; Page/Page column 3 ;
Route3
- 1146978-94-0
- ~90%
- In-stock
  
  116539-55-0
References
- US2011/275835 A1, ; Page/Page column 3 ;

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS05,GHS07
Signal Word : Danger	UN#: 1759
Class : 8	Packing Group : Ⅰ
Hazard Statements : H302-H314-H412
Precautionary Statements : P260-P264-P270-P273-P280-P301+P330+P331-P303+P361+P353-P363-P405-P501

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Computational Chemistry Data

TPSA 32.26
LogP 1.391
H_Acceptors 3
H_Donors 2
Rotatable_Bonds 4

Other Classifications

Bioactive Molecules Natural Products

Building Blocks Functional Group Amine

Building Blocks Functional Group Alcohol

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Building Blocks Skeleton Aromatic heterocycle compounds Thiophene compounds

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Duloxetine impurity 11

CAS No. 116539-55-0

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